Organic phosphonic acids and derivatives

Organic compounds that consist of phosphonic acid with organic functional group substitutions; includes compounds that are derived from organic phosphonic acids.

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166 – 180 of 459 results

166

Diethyl (3-Bromopropyl)phosphonate 95.0+%, TCI America™

CAS: 1186-10-3 Molecular Formula: C7H16BrO3P Molecular Weight (g/mol): 259.08 MDL Number: MFCD00800966 InChI Key: PEIKTSJIUKYDPC-UHFFFAOYSA-N Synonym: (3-Bromopropyl)phosphonic Acid Diethyl Ester PubChem CID: 283500 IUPAC Name: diethyl (3-bromopropyl)phosphonate SMILES: CCOP(=O)(CCCBr)OCC

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PubChem CID	283500
CAS	1186-10-3
Molecular Weight (g/mol)	259.08
MDL Number	MFCD00800966
SMILES	CCOP(=O)(CCCBr)OCC
Synonym	(3-Bromopropyl)phosphonic Acid Diethyl Ester
IUPAC Name	diethyl (3-bromopropyl)phosphonate
InChI Key	PEIKTSJIUKYDPC-UHFFFAOYSA-N
Molecular Formula	C7H16BrO3P

167

Diethyl (3-Methoxybenzyl)phosphonate 98.0+%, TCI America™

CAS: 60815-18-1 Molecular Formula: C12H19O4P Molecular Weight (g/mol): 258.25 MDL Number: MFCD08276363 InChI Key: IGGMUQNGGBRXFB-UHFFFAOYSA-N Synonym: 3-(Diethylphosphonomethyl)anisole, (3-Methoxybenzyl)phosphonic Acid Diethyl Ester PubChem CID: 10611200 IUPAC Name: diethyl [(3-methoxyphenyl)methyl]phosphonate SMILES: CCOP(=O)(CC1=CC(OC)=CC=C1)OCC

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Specifications

PubChem CID	10611200
CAS	60815-18-1
Molecular Weight (g/mol)	258.25
MDL Number	MFCD08276363
SMILES	CCOP(=O)(CC1=CC(OC)=CC=C1)OCC
Synonym	3-(Diethylphosphonomethyl)anisole, (3-Methoxybenzyl)phosphonic Acid Diethyl Ester
IUPAC Name	diethyl [(3-methoxyphenyl)methyl]phosphonate
InChI Key	IGGMUQNGGBRXFB-UHFFFAOYSA-N
Molecular Formula	C12H19O4P

168

(3-Bromopropyl)phosphonic Acid 98.0+%, TCI America™

CAS: 1190-09-6 Molecular Formula: C3H8BrO3P Molecular Weight (g/mol): 202.972 MDL Number: MFCD00191385 InChI Key: CXOIECRVHUDBSA-UHFFFAOYSA-N Synonym: 3-Bromopropanephosphonic Acid PubChem CID: 4376761 IUPAC Name: 3-bromopropylphosphonic acid SMILES: C(CP(=O)(O)O)CBr

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PubChem CID	4376761
CAS	1190-09-6
Molecular Weight (g/mol)	202.972
MDL Number	MFCD00191385
SMILES	C(CP(=O)(O)O)CBr
Synonym	3-Bromopropanephosphonic Acid
IUPAC Name	3-bromopropylphosphonic acid
InChI Key	CXOIECRVHUDBSA-UHFFFAOYSA-N
Molecular Formula	C3H8BrO3P

169

Bis(2,2,2-trifluoroethyl) (Methoxycarbonylmethyl)phosphonate 95.0+%, TCI America™

CAS: 88738-78-7 Molecular Formula: C7H9F6O5P Molecular Weight (g/mol): 318.108 MDL Number: MFCD00009901 InChI Key: PVSJXEDBEXYLML-UHFFFAOYSA-N Synonym: methyl 2-bis 2,2,2-trifluoroethoxy phosphoryl acetate,bis 2,2,2-trifluoroethyl methoxycarbonylmethyl phosphonate,methyl bis 2,2,2-trifluoroethyl phosphonoacetate,bis 2,2,2-trifluoroethyl phosphonoacetic acid methyl ester,methyl bis 2,2,2-trifluoroethoxy phosphoryl acetate,methyl p,p-bis 2,2,2-trifluoroethyl phosphonoacetate,acetic acid, bis 2,2,2-trifluoroethoxy phosphinyl-, methyl ester,acmc-209qx4 PubChem CID: 184894 IUPAC Name: methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]acetate SMILES: COC(=O)CP(=O)(OCC(F)(F)F)OCC(F)(F)F

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PubChem CID	184894
CAS	88738-78-7
Molecular Weight (g/mol)	318.108
MDL Number	MFCD00009901
SMILES	COC(=O)CP(=O)(OCC(F)(F)F)OCC(F)(F)F
Synonym	methyl 2-bis 2,2,2-trifluoroethoxy phosphoryl acetate,bis 2,2,2-trifluoroethyl methoxycarbonylmethyl phosphonate,methyl bis 2,2,2-trifluoroethyl phosphonoacetate,bis 2,2,2-trifluoroethyl phosphonoacetic acid methyl ester,methyl bis 2,2,2-trifluoroethoxy phosphoryl acetate,methyl p,p-bis 2,2,2-trifluoroethyl phosphonoacetate,acetic acid, bis 2,2,2-trifluoroethoxy phosphinyl-, methyl ester,acmc-209qx4
IUPAC Name	methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]acetate
InChI Key	PVSJXEDBEXYLML-UHFFFAOYSA-N
Molecular Formula	C7H9F6O5P

170

Diethyl Benzylphosphonate 98.0+%, TCI America™

CAS: 1080-32-6 Molecular Formula: C11H17O3P Molecular Weight (g/mol): 228.228 MDL Number: MFCD00009078 InChI Key: AIPRAPZUGUTQKX-UHFFFAOYSA-N Synonym: diethyl benzylphosphonate,benzylphosphonic acid diethyl ester,diethoxyphosphonomethylbenzene,diethyl phosphonate, benzyl,phosphonic acid, phenylmethyl-, diethyl ester,unii-t6d4qwt656,diethylbenzylphosphonate,phosphonic acid, benzyl-, diethyl ester,diethyl phenylmethyl phosphonate,phosphonic acid, p-phenylmethyl-, diethyl ester PubChem CID: 14122 IUPAC Name: diethoxyphosphorylmethylbenzene SMILES: CCOP(=O)(CC1=CC=CC=C1)OCC

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PubChem CID	14122
CAS	1080-32-6
Molecular Weight (g/mol)	228.228
MDL Number	MFCD00009078
SMILES	CCOP(=O)(CC1=CC=CC=C1)OCC
Synonym	diethyl benzylphosphonate,benzylphosphonic acid diethyl ester,diethoxyphosphonomethylbenzene,diethyl phosphonate, benzyl,phosphonic acid, phenylmethyl-, diethyl ester,unii-t6d4qwt656,diethylbenzylphosphonate,phosphonic acid, benzyl-, diethyl ester,diethyl phenylmethyl phosphonate,phosphonic acid, p-phenylmethyl-, diethyl ester
IUPAC Name	diethoxyphosphorylmethylbenzene
InChI Key	AIPRAPZUGUTQKX-UHFFFAOYSA-N
Molecular Formula	C11H17O3P

171

Tetraisopropyl Methylenediphosphonate 97.0+%, TCI America™

CAS: 1660-95-3 Molecular Formula: C13H30O6P2 Molecular Weight (g/mol): 344.325 MDL Number: MFCD00015021 InChI Key: ODTQUKVFOLFLIQ-UHFFFAOYSA-N Synonym: tetraisopropyl methylenediphosphonate,phosphonic acid, methylenebis-, tetrakis 1-methylethyl ester,tetraisopropyl methylenebisphosphonate,unii-k46y5v9u61,tetraisopropyl methylenebis phosphonate,methylenediphosphonic acid tetraisopropyl ester,tetra-i-propylmethylenediphosphonate,2-di propan-2-yloxy phosphorylmethyl-propan-2-yloxyphosphoryl oxypropane,phosphonic acid, p,p'-methylenebis-, p,p,p',p'-tetrakis 1-methylethyl ester,dsstox_cid_24847 PubChem CID: 74266 IUPAC Name: 2-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]oxypropane SMILES: CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C

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Specifications

PubChem CID	74266
CAS	1660-95-3
Molecular Weight (g/mol)	344.325
MDL Number	MFCD00015021
SMILES	CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C
Synonym	tetraisopropyl methylenediphosphonate,phosphonic acid, methylenebis-, tetrakis 1-methylethyl ester,tetraisopropyl methylenebisphosphonate,unii-k46y5v9u61,tetraisopropyl methylenebis phosphonate,methylenediphosphonic acid tetraisopropyl ester,tetra-i-propylmethylenediphosphonate,2-di propan-2-yloxy phosphorylmethyl-propan-2-yloxyphosphoryl oxypropane,phosphonic acid, p,p'-methylenebis-, p,p,p',p'-tetrakis 1-methylethyl ester,dsstox_cid_24847
IUPAC Name	2-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]oxypropane
InChI Key	ODTQUKVFOLFLIQ-UHFFFAOYSA-N
Molecular Formula	C13H30O6P2

172

Benzyl Dimethylphosphonoacetate 97.0+%, TCI America™

CAS: 57443-18-2 Molecular Formula: C11H15O5P Molecular Weight (g/mol): 258.21 InChI Key: QYLGNJMIOVHLQQ-UHFFFAOYSA-N Synonym: benzyl dimethylphosphonoacetate,benzyl 2-dimethoxyphosphoryl acetate,benzyl dimethyl phosphonoacetate,dimethyl benzyloxycarbonyl methyl phosphonate,acetic acid, dimethoxyphosphinyl-, phenylmethyl ester,acmc-209ly9,benzyl dimethylphosphonoethanoate,dimethyl cbz-methyl phosphonate,benzyl dimethoxyphosphoryl acetate,benzyl-2-dimethoxyphosphoryl acetate PubChem CID: 2773759 IUPAC Name: benzyl 2-dimethoxyphosphorylacetate SMILES: COP(=O)(CC(=O)OCC1=CC=CC=C1)OC

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PubChem CID	2773759
CAS	57443-18-2
Molecular Weight (g/mol)	258.21
SMILES	COP(=O)(CC(=O)OCC1=CC=CC=C1)OC
Synonym	benzyl dimethylphosphonoacetate,benzyl 2-dimethoxyphosphoryl acetate,benzyl dimethyl phosphonoacetate,dimethyl benzyloxycarbonyl methyl phosphonate,acetic acid, dimethoxyphosphinyl-, phenylmethyl ester,acmc-209ly9,benzyl dimethylphosphonoethanoate,dimethyl cbz-methyl phosphonate,benzyl dimethoxyphosphoryl acetate,benzyl-2-dimethoxyphosphoryl acetate
IUPAC Name	benzyl 2-dimethoxyphosphorylacetate
InChI Key	QYLGNJMIOVHLQQ-UHFFFAOYSA-N
Molecular Formula	C11H15O5P

173

Diethyl (Methoxymethyl)phosphonate 98.0+%, TCI America™

CAS: 32806-04-5 Molecular Formula: C6H15O4P Molecular Weight (g/mol): 182.16 MDL Number: MFCD00137944 InChI Key: IWEOGHGFCXMKFM-UHFFFAOYSA-N Synonym: (Methoxymethyl)phosphonic Acid Diethyl Ester PubChem CID: 11658394 IUPAC Name: diethyl (methoxymethyl)phosphonate SMILES: CCOP(=O)(COC)OCC

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Specifications

PubChem CID	11658394
CAS	32806-04-5
Molecular Weight (g/mol)	182.16
MDL Number	MFCD00137944
SMILES	CCOP(=O)(COC)OCC
Synonym	(Methoxymethyl)phosphonic Acid Diethyl Ester
IUPAC Name	diethyl (methoxymethyl)phosphonate
InChI Key	IWEOGHGFCXMKFM-UHFFFAOYSA-N
Molecular Formula	C6H15O4P

174

1,4-Butylenediphosphonic Acid 98.0+%, TCI America™

CAS: 4671-77-6 Molecular Formula: C4H8O6P2 Molecular Weight (g/mol): 214.05 MDL Number: MFCD01631212 InChI Key: JKTORXLUQLQJCM-UHFFFAOYSA-J Synonym: 1,4-butanediphosphonic acid,1,4-butylenediphosphonic acid,1,4-diphosphonobutane,tetramethylene phosphonic acid,butane-1,4-bisphosphonic acid,tetramethylenebisphosphonic acid,butane-1,4-diyldiphosphonic acid PubChem CID: 437082 IUPAC Name: (4-phosphonatobutyl)phosphonate SMILES: [O-]P([O-])(=O)CCCCP([O-])([O-])=O

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PubChem CID	437082
CAS	4671-77-6
Molecular Weight (g/mol)	214.05
MDL Number	MFCD01631212
SMILES	[O-]P([O-])(=O)CCCCP([O-])([O-])=O
Synonym	1,4-butanediphosphonic acid,1,4-butylenediphosphonic acid,1,4-diphosphonobutane,tetramethylene phosphonic acid,butane-1,4-bisphosphonic acid,tetramethylenebisphosphonic acid,butane-1,4-diyldiphosphonic acid
IUPAC Name	(4-phosphonatobutyl)phosphonate
InChI Key	JKTORXLUQLQJCM-UHFFFAOYSA-J
Molecular Formula	C4H8O6P2

175

m-Xylylenediphosphonic Acid 97.0+%, TCI America™

CAS: 144052-40-4 Molecular Formula: C8H12O6P2 Molecular Weight (g/mol): 266.126 MDL Number: MFCD22200402 InChI Key: PYWZCUXISXXGMI-UHFFFAOYSA-N PubChem CID: 19352865 IUPAC Name: [3-(phosphonomethyl)phenyl]methylphosphonic acid SMILES: C1=CC(=CC(=C1)CP(=O)(O)O)CP(=O)(O)O

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PubChem CID	19352865
CAS	144052-40-4
Molecular Weight (g/mol)	266.126
MDL Number	MFCD22200402
SMILES	C1=CC(=CC(=C1)CP(=O)(O)O)CP(=O)(O)O
IUPAC Name	[3-(phosphonomethyl)phenyl]methylphosphonic acid
InChI Key	PYWZCUXISXXGMI-UHFFFAOYSA-N
Molecular Formula	C8H12O6P2

176

Tetraethyl p-Xylylenediphosphonate 95.0+%, TCI America™

CAS: 4546-04-7 Molecular Formula: C16H28O6P2 Molecular Weight (g/mol): 378.34 MDL Number: MFCD00671576 InChI Key: XTKQUBKFKSHRPS-UHFFFAOYSA-N Synonym: p-Bis(diethylphosphono)xylene, p-Xylylenediphosphonic Acid Tetraethyl Ester PubChem CID: 78303 IUPAC Name: 1,4-bis(diethoxyphosphorylmethyl)benzene SMILES: CCOP(=O)(CC1=CC=C(C=C1)CP(=O)(OCC)OCC)OCC

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PubChem CID	78303
CAS	4546-04-7
Molecular Weight (g/mol)	378.34
MDL Number	MFCD00671576
SMILES	CCOP(=O)(CC1=CC=C(C=C1)CP(=O)(OCC)OCC)OCC
Synonym	p-Bis(diethylphosphono)xylene, p-Xylylenediphosphonic Acid Tetraethyl Ester
IUPAC Name	1,4-bis(diethoxyphosphorylmethyl)benzene
InChI Key	XTKQUBKFKSHRPS-UHFFFAOYSA-N
Molecular Formula	C16H28O6P2

177

Diethyl Allylphosphonate 95.0+%, TCI America™

CAS: 1067-87-4 Molecular Formula: C7H15O3P Molecular Weight (g/mol): 178.17 MDL Number: MFCD00015134 InChI Key: YPJHXRAHMUKXAE-UHFFFAOYSA-N Synonym: diethyl allylphosphonate,diethyl prop-2-en-1-ylphosphonate,diethyl-allylphosphonate,acmc-1bprn,phosphonic acid, 2-propenyl-, diethyl ester,allylphosphonic acid diethyl,3-diethoxyphosphoryl-prop-1-ene,allylphosphonic acid diethyl ester,allyl phosphonic acid diethyl ester PubChem CID: 573014 IUPAC Name: diethyl (prop-2-en-1-yl)phosphonate SMILES: CCOP(=O)(CC=C)OCC

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PubChem CID	573014
CAS	1067-87-4
Molecular Weight (g/mol)	178.17
MDL Number	MFCD00015134
SMILES	CCOP(=O)(CC=C)OCC
Synonym	diethyl allylphosphonate,diethyl prop-2-en-1-ylphosphonate,diethyl-allylphosphonate,acmc-1bprn,phosphonic acid, 2-propenyl-, diethyl ester,allylphosphonic acid diethyl,3-diethoxyphosphoryl-prop-1-ene,allylphosphonic acid diethyl ester,allyl phosphonic acid diethyl ester
IUPAC Name	diethyl (prop-2-en-1-yl)phosphonate
InChI Key	YPJHXRAHMUKXAE-UHFFFAOYSA-N
Molecular Formula	C7H15O3P

178

Diethyl 1-Pyrrolidinemethylphosphonate 95.0+%, TCI America™

CAS: 51868-96-3 Molecular Formula: C9H21NO3P Molecular Weight (g/mol): 222.24 MDL Number: MFCD00040516 InChI Key: DOMZGECNJWVKAM-UHFFFAOYSA-O Synonym: 1-Pyrrolidinemethylphosphonic Acid Diethyl Ester PubChem CID: 103998 IUPAC Name: 1-[(diethoxyphosphoryl)methyl]pyrrolidin-1-ium SMILES: CCOP(=O)(C[NH+]1CCCC1)OCC

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PubChem CID	103998
CAS	51868-96-3
Molecular Weight (g/mol)	222.24
MDL Number	MFCD00040516
SMILES	CCOP(=O)(C[NH+]1CCCC1)OCC
Synonym	1-Pyrrolidinemethylphosphonic Acid Diethyl Ester
IUPAC Name	1-[(diethoxyphosphoryl)methyl]pyrrolidin-1-ium
InChI Key	DOMZGECNJWVKAM-UHFFFAOYSA-O
Molecular Formula	C9H21NO3P

179

Sodium Ibandronate 90.0+%, TCI America™

CAS: 138844-81-2 Molecular Formula: C9H22NNaO7P2 Molecular Weight (g/mol): 341.21 MDL Number: MFCD07197214 InChI Key: LXLBEOAZMZAZND-UHFFFAOYNA-M Synonym: ibandronate sodium,bondronat,boniva,ibandronate sodium salt,sodium ibandronate,1-hydroxy-3-methylpentylamino propylidene bisphosphonic acid sodium,phosphonic acid, 1-hydroxy-3-methylpentylamino propylidene bis-, monosodium salt,sodiumibandronate,ibandronic acid sodium salt PubChem CID: 23670359 IUPAC Name: sodium hydrogen {1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl}phosphonate SMILES: [Na+].CCCCCN(C)CCC(O)(P(O)(O)=O)P(O)([O-])=O

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PubChem CID	23670359
CAS	138844-81-2
Molecular Weight (g/mol)	341.21
MDL Number	MFCD07197214
SMILES	[Na+].CCCCCN(C)CCC(O)(P(O)(O)=O)P(O)([O-])=O
Synonym	ibandronate sodium,bondronat,boniva,ibandronate sodium salt,sodium ibandronate,1-hydroxy-3-methylpentylamino propylidene bisphosphonic acid sodium,phosphonic acid, 1-hydroxy-3-methylpentylamino propylidene bis-, monosodium salt,sodiumibandronate,ibandronic acid sodium salt
IUPAC Name	sodium hydrogen {1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl}phosphonate
InChI Key	LXLBEOAZMZAZND-UHFFFAOYNA-M
Molecular Formula	C9H22NNaO7P2

180

Diethyl Phenylphosphonate 96.0+%, TCI America™

CAS: 1754-49-0 Molecular Formula: C10H15O3P Molecular Weight (g/mol): 214.20 MDL Number: MFCD00015136 InChI Key: VZEGPPPCKHRYGO-UHFFFAOYSA-N Synonym: diethyl phenylphosphonate,diethyl benzenephosphonate,phenylphosphonic acid diethyl ester,phosphonic acid, phenyl-, diethyl ester,benzenephosphonic acid, diethyl ester,diethoxyphosphoryl-benzene,acmc-1c01k,phenylphosphonic acid diethyl,wln: 2vopo&r&ov2,benzenephosphonic acid diethyl ester PubChem CID: 15642 IUPAC Name: diethyl phenylphosphonate SMILES: CCOP(=O)(OCC)C1=CC=CC=C1

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PubChem CID	15642
CAS	1754-49-0
Molecular Weight (g/mol)	214.20
MDL Number	MFCD00015136
SMILES	CCOP(=O)(OCC)C1=CC=CC=C1
Synonym	diethyl phenylphosphonate,diethyl benzenephosphonate,phenylphosphonic acid diethyl ester,phosphonic acid, phenyl-, diethyl ester,benzenephosphonic acid, diethyl ester,diethoxyphosphoryl-benzene,acmc-1c01k,phenylphosphonic acid diethyl,wln: 2vopo&r&ov2,benzenephosphonic acid diethyl ester
IUPAC Name	diethyl phenylphosphonate
InChI Key	VZEGPPPCKHRYGO-UHFFFAOYSA-N
Molecular Formula	C10H15O3P

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